4-Chlorophthalic acid
TL;DR: 4-Chlorophthalic acid (CAS 89-20-3) is a chemical compound with molecular formula C8H5ClO4 and molecular weight 199.98764 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-chlorophthalic acid
Also Known As: 4-CHLOROPHTHALIC ACID, 4-Chlorophthalicacid, Phthalic acid, 4-chloro-, 4-Chloro-phthalic acid, 4-chlorphthalsyre
Application Areas
Top 5 of 18 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C8H5ClO4 |
| Molecular Weight | 199.98764 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 199.98764 Da |
| Heavy Atoms | 13 |
| Complexity | 228.0 |
| SMILES | C1=CC(=C(C=C1Cl)C(=O)O)C(=O)O |
| InChIKey | DVIPPHSQIBKWSA-UHFFFAOYSA-N |
Product Description
Applications: 4-Chlorophthalic acid is used in complex organic molecule assembly across discovery and process chemistry, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
4-Chlorophthalic acid is a organic building block identified by CAS number 89-20-3 and the molecular formula C8H5ClO4 and a molecular weight of 199.99 g/mol. Synonyms include 4-CHLOROPHTHALIC ACID and 4-Chlorophthalicacid.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of 4-Chlorophthalic acid
Property Insights of 4-Chlorophthalic acid
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Chlorophthalic acid. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Chlorophthalic acid. Following Lipinski's Rule of Five, 4-Chlorophthalic acid has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-Chlorophthalic acid?
The CAS number of 4-Chlorophthalic acid is 89-20-3.
What is the molecular formula of 4-Chlorophthalic acid?
The molecular formula of 4-Chlorophthalic acid is C8H5ClO4.
What is the molecular weight of 4-Chlorophthalic acid?
The molecular weight of 4-Chlorophthalic acid is 199.98764 g/mol.
What are the applications of 4-Chlorophthalic acid?
4-Chlorophthalic acid is used in complex organic molecule assembly across discovery and process chemistry, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as...
Where can I buy 4-Chlorophthalic acid?
You can request a quote for 4-Chlorophthalic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Chlorophthalic acid?
Yes, CoreyChem provides custom synthesis services for 4-Chlorophthalic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.